SCHEMBL11271873

SCHEMBL11271873

CCOc1nc2cc(-c3cc(C)nc(C)c3)ccc2[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.39
FGFR1 P11362 2/20 0.36
FGFR2 P21802 2/20 0.36
TLR9 Q9NR96 5/20 0.36
TLR8 Q9NR97 5/20 0.36
TLR7 Q9NYK1 5/20 0.36
MAPT P10636 3/20 0.36
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
ESR2 Q92731 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11275736 0.89 ABL1 (0.45) KDM4CTLR9TLR8TLR7MMP2
SCHEMBL11271590 0.86 NPC1 (0.46) KDM4CFGFR1FGFR2MAPTHSD17B10
SCHEMBL11271918 0.82 MMP2 (0.49) KDM4CTLR9TLR8TLR7MAPT
Water SCHEMBL11275606 0.81 MMP2 (0.48) KDM4CTLR9TLR8TLR7MAPT
SCHEMBL20436746 0.80 KDM4C (0.43) KDM4CMAPTHSD17B10ALDH1A1HPGD
SCHEMBL11270413 0.78 CYP11B2 (0.58) KDM4CFGFR1TLR8TLR7MAPT
SCHEMBL11263840 0.77 KDM4C (0.38) KDM4CFGFR1FGFR2TLR9TLR8
SCHEMBL11265691 0.75 TLR8 (0.39) TLR9TLR8TLR7MAPTNPC1
SCHEMBL11268351 0.75 TLR8 (0.39) TLR9TLR8TLR7
SCHEMBL31578022 0.74 CYP1A2 (0.46) KDM4CMAPTHSD17B10ALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0055453-A2 5-(Pyridinyl)-benzimidazole derivatives and preparation STERLING DRUG INC. (US) 1982-07-07 EP disclosed
US-4335132-A 5-(Py-Y)-1H-benzimidazol-2-ols and 5-(Py-Y-)-1H-benzimidazole-2-thiols STERLING DRUG, INC. (US) 1982-06-15 US disclosed